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Publications by Marcus A. Neumann

Disorder in Mixed Crystals Ofcis/Trans-Perinone Explained by D-DFT Calculations

Acta Crystallographica Section A Foundations of Crystallography

English

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Calculations of Mössbauer Parameters in Solids by DFT Bandstructure Calculations

Journal of Physics: Conference Series

English

Proton Transfers in the Strecker Reaction Revealed by DFT Calculations

Beilstein Journal of Organic Chemistry

Organic Chemistry

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Theoratical Calculations of LASO Molecule by Using DFT/B3LYP and DFT/HSEH1PBE Levels

Sakarya University Journal of Science

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Synthesis and Structure Ofcis-Trans-Cis-1,3,5,7-Tetraisocyanato-1,3,5,7-Tetramethylcyclotetrasiloxane

Chemistry Letters

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Dissociation of Basic Dyes by Advanced Oxidation: Theoretical Study by DFT Calculations

Chemical Science Transactions

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Structure and Sources of Disorder in Poly(3-Hexylthiophene) Crystals Investigated by Density Functional Calculations With Van Der Waals Interactions

Physical Review B

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Adsorption of 2,4,6-Trichlorophenol on Kaolinite: DFT Calculations

Aceh International Journal of Science and Technology

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Dielectric Properties of NaNH4SO4·2H2O-NaNH4SeO4·2H2O Mixed Crystals Mixed Crystals

Acta Physica Polonica A

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Dynamical Diffraction Calculations of Incommensurate Modulations in Crystals

Microscopy and Microanalysis

Instrumentation

English